N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-morpholin-4-yl-pyridine-3-carboxamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-morpholin-4-yl-pyridine-3-carboxamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-morpholino-pyridine-3-carboxamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-2-(4-morpholinyl)-3-pyridinecarboxamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-morpholin-4-ylpyridine-3-carboxamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-2-morpholino-nicotinamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)N4CCOCC4)C

InChI

InChI=1S/C22H23N5O2S/c1-15-14-16(2)25-22(24-15)30-18-7-5-17(6-8-18)26-21(28)19-4-3-9-23-20(19)27-10-12-29-13-11-27/h3-9,14H,10-13H2,1-2H3,(H,26,28)